smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CC[N@@H+]1CC[C@H](Oc2ccc([C@H](Oc3ccc4c(c3)CN(C(N)=[NH2+])CC4)C(=O)OCC)cc2)C1	ZINC000013782217	562992443	/nfs/dbraw/zinc/99/24/43/562992443.db2.gz	LXPHZHBUHUZDRJ-DQEYMECFSA-N	2	1	478.593	3.260	1	30		JGEFMP
C=CC[N@H+]1C[C@@H](C(=O)N(CCC[NH+](C)C)C(=O)NCC)C[C@@H]2c3cccc4[nH]cc(c43)C[C@@H]21	ZINC000003830351	554470923	/nfs/dbraw/zinc/47/09/23/554470923.db2.gz	KORNTPPJEAJQIU-WPYKKVEZSA-N	2	1	451.615	3.194	1	30		JGEFMP
CC(=NNC(N)=[NH2+])c1ccc(NC(=O)c2ccc(Nc3cc[n+](C)c4cc(N)ccc34)cc2)cc1	ZINC000038811367	563135651	/nfs/dbraw/zinc/13/56/51/563135651.db2.gz	YOJCMEFPZGZFGG-UHFFFAOYSA-O	2	1	467.557	3.449	1	30		JGEFMP
CC(=NNC(N)=[NH2+])c1ccc(NC(=O)c2ccc(Nc3cc[n+](C)c4ccc(N)cc34)cc2N)cc1	ZINC000038174048	563133032	/nfs/dbraw/zinc/13/30/32/563133032.db2.gz	YUZSEEHYZITWSG-UHFFFAOYSA-O	2	1	482.572	3.032	1	30		JGEFMP
C=CC[N@@H+]1CC[C@H](Oc2ccc([C@@H](Oc3ccc4c(c3)CN(C(N)=[NH2+])CC4)C(=O)OCC)cc2)C1	ZINC000013782218	562992398	/nfs/dbraw/zinc/99/23/98/562992398.db2.gz	LXPHZHBUHUZDRJ-LOSJGSFVSA-N	2	1	478.593	3.260	1	30		JGEFMP
CS(=O)(=O)N(Cc1ccc2ccc(C(N)=[NH2+])cc2c1)C1CC[NH+](Cc2cccc(C#N)c2)CC1	ZINC000028714190	563077544	/nfs/dbraw/zinc/07/75/44/563077544.db2.gz	ZHNIAMXHSGWPMU-UHFFFAOYSA-N	2	1	475.618	3.422	1	30		JGEFMP
CC(=NNC(N)=[NH2+])c1ccc(NC(=O)c2ccc(Nc3cc[n+](C)c4ccc(N)cc34)cc2)cc1	ZINC000038811365	563135622	/nfs/dbraw/zinc/13/56/22/563135622.db2.gz	BKTSGBCGIGTNOC-UHFFFAOYSA-O	2	1	467.557	3.449	1	30		JGEFMP
CC(=NNC(N)=[NH2+])c1ccc(C(=O)Nc2ccc(Nc3cc[n+](C)c4cc(N)ccc34)cc2)cc1	ZINC000038174357	563133034	/nfs/dbraw/zinc/13/30/34/563133034.db2.gz	BESIRWXDBOAGHC-UHFFFAOYSA-O	2	1	467.557	3.449	1	30		JGEFMP